3,5-Bis(trifluoromethyl)anisole
Properties
- Molecular formula
- C9H6F6O
- Molar mass
- 244.14 g/mol
- Exact mass
- 244.0323 Da
- logP
- 3.73Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H226 Flammable liquid and vapor100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
349-60-0SMILES
COC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)FInChIKey
HQZFGUOTUIHWLR-UHFFFAOYSA-NInChI
InChI=1S/C9H6F6O/c1-16-7-3-5(8(10,11)12)2-6(4-7)9(13,14)15/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3,5-Bis(trifluoromethyl)anisole
Similar compounds
5-(Trifluoromethyl)-m-anisidine349-55-371 % similar
1-Methoxy-3-(trifluoromethyl)benzene454-90-064 % similar
1-Methoxy-4-(trifluoromethyl)benzene402-52-862 % similar
3-Methoxy-5-nitrobenzotrifluoride328-79-059 % similar
3-Methoxy-5-(trifluoromethyl)benzoic acid53985-48-159 % similar
1,3,5-Tris(trifluoromethyl)benzene729-81-757 % similar
1,3,5-Trimethoxybenzene621-23-850 % similar
3,5-Bis(trifluoromethyl)toluene75462-61-250 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds